CBKinase1_008719
TL;DR: CBKinase1_008719 (CAS 712283-06-2) is a chemical compound with molecular formula C21H16F2N6OS and molecular weight 438.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(3,4-difluorophenyl)-2-[[4-(4-methylphenyl)-5-pyrazin-2-yl-1,2,4-triazol-3-yl]sulfanyl]acetamide
Also Known As: CBKinase1_008719, CBKinase1_021119, BRD-K39356312-001-01-7, N-(3,4-difluorophenyl)-2-[[4-(4-methylphenyl)-5-pyrazin-2-yl-1,2,4-triazol-3-yl]sulfanyl]acetamide, N-(3,4-difluorophenyl)-2-{[4-(4-methylphenyl)-5-(pyrazin-2-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetamide
| Molecular Formula | C21H16F2N6OS |
|---|---|
| Molecular Weight | 438.11 g/mol |
| LogP | 4.04172 |
| Topological Polar Surface Area | 85.59 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 6 |
| Exact Mass | 438.10742 |
| Heavy Atoms | 31 |
| Complexity | 1214.5344 |
Chemical Identifiers
| CAS Number | 712283-06-2 |
|---|---|
| SMILES | CC1=CC=C(C=C1)N2C(=NN=C2SCC(=O)NC3=CC(=C(C=C3)F)F)C4=NC=CN=C4 |
Product Overview
CBKinase1_008719 (CAS 712283-06-2), with molecular formula C21H16F2N6OS and molecular weight 438.11 g/mol. IUPAC: N-(3,4-difluorophenyl)-2-[[4-(4-methylphenyl)-5-pyrazin-2-yl-1,2,4-triazol-3-yl]sulfanyl]acetamide.
Chemical Property Profile of CBKinase1_008719
Property Insights of CBKinase1_008719
The XLogP value of 4.04172 indicates that CBKinase1_008719 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 85.59 Ų falls within the moderate polarity range, balancing permeability and solubility for CBKinase1_008719. Following Lipinski's Rule of Five, CBKinase1_008719 has 1 hydrogen bond donor(s) and 6 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of CBKinase1_008719?
The CAS number of CBKinase1_008719 is 712283-06-2.
What is the molecular formula of CBKinase1_008719?
The molecular formula of CBKinase1_008719 is C21H16F2N6OS.
What is the molecular weight of CBKinase1_008719?
The molecular weight of CBKinase1_008719 is 438.11 g/mol.
Where can I buy CBKinase1_008719?
You can request a quote for CBKinase1_008719 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for CBKinase1_008719?
Yes, KEHONG BIO provides custom synthesis services for CBKinase1_008719 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.